methyl (4S,6R)-2-methyl-4,6-bis(oxidanyl)-6-phenyl-hexanoate

Systemtic Name: methyl (4S,6R)-2-methyl-4,6-bis(oxidanyl)-6-phenyl-hexanoate Openeye Name: methyl (4S,6R)-4,6-dihydroxy-2-methyl-6-phenyl-hexanoate CAS Name: (4S,6R)-4,6-dihydroxy-2-methyl-6-phenylhexanoic acid methyl ester IUPAC Name: methyl (4S,6R)-4,6-dihydroxy-2-methyl-6-phenylhexanoate Traditional Name: (4S,6R)-4,6-dihydroxy-2-methyl-6-phenyl-hexanoic acid methyl ester Formula: C14H17O4 MolecularWeight: 249.28238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)[C]([CH2])[CH]C(CC(C1=CC=CC=C1)O)O

Isomeric SMILES

COC(=O)[C]([CH2])[CH][C@@H](C[C@H](C1=CC=CC=C1)O)O

InChI

InChI=1S/C14H17O4/c1-10(14(17)18-2)8-12(15)9-13(16)11-6-4-3-5-7-11/h3-8,12-13,15-16H,1,9H2,2H3/t12-,13+/m0/s1